[1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol

C15H25NOS — CID 79137906

IUPAC[1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol
SMILESCCc1ccc(C(O)C2(CN)CCC(CC)C2)s1
InChIInChI=1S/C15H25NOS/c1-3-11-7-8-15(9-11,10-16)14(17)13-6-5-12(4-2)18-13/h5-6,11,14,17H,3-4,7-10,16H2,1-2H3
InChIKeyVBLJLROBTWLNGM-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.50
Rot. Bonds5

About [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol

[1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol (PubChem CID 79137906) has the molecular formula C15H25NOS and a molecular weight of 267.44 g/mol. Its IUPAC name is [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol.

Molecular Properties

Compound Name[1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol
PubChem CID79137906
Molecular FormulaC15H25NOS
Molecular Weight267.44 g/mol
Exact Mass267.17
IUPAC Name[1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol
SMILESCCc1ccc(C(O)C2(CN)CCC(CC)C2)s1
InChIInChI=1S/C15H25NOS/c1-3-11-7-8-15(9-11,10-16)14(17)13-6-5-12(4-2)18-13/h5-6,11,14,17H,3-4,7-10,16H2,1-2H3
InChIKeyVBLJLROBTWLNGM-UHFFFAOYSA-N
XLogP3.50
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(aminomethyl)-4-ethylcyclohexyl]-(5-chlorothiophen-2-yl)methanol
CID 79137694
3-ethyl-1-[(5-ethylthiophen-2-yl)-hydroxymethyl]cyclohexane-1-carbonitrile
CID 79131786
[1-(aminomethyl)-3-ethylcyclopentyl]-(5-bromofuran-2-yl)methanol
CID 79135075
[1-(aminomethyl)-3-ethylcyclopentyl]-(2-ethylphenyl)methanol
CID 79138474
[1-(aminomethyl)-3-ethylcyclopentyl]-(2,6-dichlorophenyl)methanol
CID 79135807
[1-(aminomethyl)-4-ethylcyclohexyl]-(5-methylfuran-2-yl)methanol
CID 79134973
[1-(aminomethyl)-3-ethylcyclopentyl]-(3,5-dichlorophenyl)methanol
CID 79138188
[1-(aminomethyl)-3-ethylcyclopentyl]-(4-bromothiophen-3-yl)methanol
CID 112739883
[1-(aminomethyl)-4-ethylcyclohexyl]-(5-ethylfuran-2-yl)methanol
CID 79138645
[1-(aminomethyl)-3-ethylcyclopentyl]-(3-bromo-4-chlorophenyl)methanol
CID 83241847
[1-(aminomethyl)-4-ethylcyclohexyl]-(4-bromo-5-chlorothiophen-2-yl)methanol
CID 102845379
[1-(aminomethyl)-3-ethylcyclopentyl]-(3-cyclopropylphenyl)methanol
CID 79977381

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol?
The IUPAC name of [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol (CID 79137906) is [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol.
What is the SMILES notation for [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol?
The canonical SMILES for [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol is CCc1ccc(C(O)C2(CN)CCC(CC)C2)s1.
What is the InChIKey of [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol?
The InChIKey is VBLJLROBTWLNGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NOS/c1-3-11-7-8-15(9-11,10-16)14(17)13-6-5-12(4-2)18-13/h5-6,11,14,17H,3-4,7-10,16H2,1-2H3.
What are the key properties of [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol?
[1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol has a molecular weight of 267.44 g/mol, XLogP of 3.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)-3-ethylcyclopentyl]-(5-ethylthiophen-2-yl)methanol is sourced from PubChem (CID 79137906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).